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N-(4-chlorophenyl)-N-(2-(4-fluorophenyl)-2-hydroxyethyl)-2-(1H-1,2,4-triazol-1-yl)acetamide
SpectraBase Compound ID BXbntYIVl66
InChI InChI=1S/C18H16ClFN4O2/c19-14-3-7-16(8-4-14)24(18(26)10-23-12-21-11-22-23)9-17(25)13-1-5-15(20)6-2-13/h1-8,11-12,17,25H,9-10H2
InChIKey MXRFCVNAKRRUCG-UHFFFAOYSA-N
Mol Weight 374.8 g/mol
Molecular Formula C18H16ClFN4O2
Exact Mass 374.094582 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6ncmB3OnDaO
Name N-(4-chlorophenyl)-N-(2-(4-fluorophenyl)-2-hydroxyethyl)-2-(1H-1,2,4-triazol-1-yl)acetamide
Appearance White solid
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Formula C18H16ClFN4O2
InChI InChI=1S/C18H16ClFN4O2/c19-14-3-7-16(8-4-14)24(18(26)10-23-12-21-11-22-23)9-17(25)13-1-5-15(20)6-2-13/h1-8,11-12,17,25H,9-10H2
InChIKey MXRFCVNAKRRUCG-UHFFFAOYSA-N
Instrument Name FinniganTrace
Ionization Type EI
Molecular Weight 374.803 g/mol
SMILES OC(CN(C(C[n]1ncnc1)=O)c1ccc(cc1)Cl)c1ccc(cc1)F
SPLASH splash10-0pir-0925000000-19850329cf887bfca638
Source of Spectrum CN106243054A
Wiley ID 1852896